3-[2-[bis(2-methylpropyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[bis(2-methylpropyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(diisobutylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-[bis(2-methylpropyl)amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-[bis(2-methylpropyl)amino]-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(diisobutylamino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C19H24N3O4- MolecularWeight: 358.41156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)[O-]

Isomeric SMILES

CC(C)CN(CC(C)C)C(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)[O-]

InChI

InChI=1S/C19H25N3O4/c1-12(2)9-21(10-13(3)4)16(23)11-22-18(24)15-8-6-5-7-14(15)17(20-22)19(25)26/h5-8,12-13H,9-11H2,1-4H3,(H,25,26)/p-1